(3S)-3-[2-[6-methyl-3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]ethanoylamino]-4-oxidanylidene-5-phenoxy-pentanoic acid

Systemtic Name: (3S)-3-[2-[6-methyl-3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]ethanoylamino]-4-oxidanylidene-5-phenoxy-pentanoic acid Openeye Name: (3S)-3-[[2-[6-methyl-3-(naphthalene-2-carbonylamino)-2-oxo-1-pyridyl]acetyl]amino]-4-oxo-5-phenoxy-pentanoic acid CAS Name: (3S)-3-[[2-[6-methyl-3-[[2-naphthalenyl(oxo)methyl]amino]-2-oxo-1-pyridinyl]-1-oxoethyl]amino]-4-oxo-5-phenoxypentanoic acid IUPAC Name: (3S)-3-[[2-[6-methyl-3-(naphthalene-2-carbonylamino)-2-oxopyridin-1-yl]acetyl]amino]-4-oxo-5-phenoxypentanoic acid Traditional Name: (3S)-4-keto-3-[[2-[2-keto-6-methyl-3-(2-naphthoylamino)-1-pyridyl]acetyl]amino]-5-phenoxy-valeric acid Formula: C30H27N3O7 MolecularWeight: 541.55128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1CC(=O)NC(CC(=O)O)C(=O)COC2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=C(C(=O)N1CC(=O)N[C@@H](CC(=O)O)C(=O)COC2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H27N3O7/c1-19-11-14-24(32-29(38)22-13-12-20-7-5-6-8-21(20)15-22)30(39)33(19)17-27(35)31-25(16-28(36)37)26(34)18-40-23-9-3-2-4-10-23/h2-15,25H,16-18H2,1H3,(H,31,35)(H,32,38)(H,36,37)/t25-/m0/s1